%chk=000071304.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071304

0 1
 O   -2.621500      -1.534600      0.6671000    
 O   -7.168400      -2.276300     -0.2226000    
 N   0.4260000       1.390000     -0.3163000    
 N   -3.253900       1.369200      0.3271000    
 N    6.559800       1.291400      0.9376000    
 N   -6.394700     -8.1900001E-02 -0.2199000    
 N   -5.298000       2.120100     -0.1507000    
 N   -4.894800      -1.931100      0.2241000    
 C    3.183100      0.3927000     -0.2178000    
 C    2.733100       1.479400      -1.207800    
 C    2.261400      0.3941000       1.012600    
 C    1.243700       1.348600      -1.536100    
 C   0.7891000      0.3033000      0.6034000    
 C    4.645900      0.5057000      0.1480000    
 C  -0.9963000       1.322200     -0.6517000    
 C   -1.840400       1.407500      0.6166000    
 C    5.655400     -0.4587000     -0.1096000    
 C    5.227300       1.569700      0.7915000    
 C    6.849600      5.9000000E-02  0.3965000    
 C   -4.055300      0.2671000      0.2408000    
 C    5.672800      -1.725800     -0.7255000    
 C    8.065100     -0.6299000      0.3172000    
 C   -5.299700      0.7546000     -5.2499998E-02
 C   -4.047400       2.460500      8.3700001E-02
 C    6.881400      -2.426400     -0.8121000    
 C   -3.745700      -1.116200      0.4041000    
 C    8.058000      -1.885000     -0.2981000    
 C   -6.230100      -1.483200     -8.4500000E-02
 C   -7.701100      0.4847000     -0.5315000    
 C   -4.704500      -3.370800      0.3664000    
 H    3.038000     -0.5737000     -0.7209000    
 H    3.318100       1.409500      -2.133200    
 H    2.924700       2.477500     -0.7919000    
 H    2.417300       1.306200       1.604200    
 H    2.511500     -0.4495000       1.668200    
 H   0.9675000       2.179500      -2.196800    
 H    1.070000      0.4185000      -2.093200    
 H   0.5858000     -0.6788000      0.1568000    
 H   0.2448000      0.3590000       1.548800    
 H   -1.230700      0.3997000      -1.199800    
 H   -1.259700       2.158900      -1.311600    
 H   -1.643700       2.349600       1.144300    
 H   -1.669100      0.6045000       1.334700    
 H    4.819200       2.500500       1.160100    
 H    7.233800       1.901600       1.378700    
 H    4.767000      -2.165800      -1.132500    
 H    8.981600     -0.2092000      0.7170000    
 H   -3.661300       3.470800      8.9000002E-02
 H    6.900800      -3.404200      -1.286100    
 H    8.985600      -2.446400     -0.3761000    
 H   -8.462100     -0.2931000     -0.6340000    
 H   -7.633200       1.038400      -1.473000    
 H   -7.996100       1.162900      0.2751000    
 H   -3.672100      -3.641600      0.5984000    
 H   -5.004000      -3.856400     -0.5679000    
 H   -5.360700      -3.732300       1.164400    


%chk=000071304-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000071304

0 1
O -2.428203 -1.467703 0.701639
O -6.966846 -2.490537 -0.074674
N 0.394267 1.353097 -0.440554
N -3.295485 1.522917 0.408410
N 6.718596 1.340011 0.679867
N -6.366418 -0.221461 -0.072876
N -5.476201 2.089604 -0.010179
N -4.717312 -1.949016 0.305732
C 3.256368 0.629096 -0.620789
C 2.716571 2.019783 -1.036395
C 2.302039 0.020338 0.450820
C 1.250723 1.931466 -1.505172
C 0.850053 -0.011180 -0.059617
C 4.694581 0.654983 -0.150529
C -1.052475 1.413187 -0.726094
C -1.833686 1.646665 0.593718
C 5.579648 -0.497317 -0.053176
C 5.427752 1.751790 0.305394
C 6.841135 -0.037527 0.469150
C -4.019735 0.322433 0.315464
C 5.431326 -1.874981 -0.368197
C 7.935474 -0.904743 0.682765
C -5.348149 0.709328 0.065371
C -4.208953 2.541487 0.199009
C 6.518205 -2.745675 -0.158680
C -3.606476 -1.049242 0.464346
C 7.757016 -2.266085 0.362723
C -6.076913 -1.601156 0.043885
C -7.751019 0.216872 -0.336223
C -4.451515 -3.401405 0.426683
H 3.199009 -0.030773 -1.515963
H 3.339860 2.445855 -1.846288
H 2.764365 2.709464 -0.170472
H 2.356848 0.632761 1.370844
H 2.626008 -1.004119 0.713426
H 0.872642 2.941871 -1.750483
H 1.205092 1.319514 -2.444795
H 0.780584 -0.704602 -0.938829
H 0.173199 -0.417068 0.712640
H -1.430929 0.481044 -1.207314
H -1.255530 2.250477 -1.420242
H -1.613553 2.653545 0.986336
H -1.519236 0.900211 1.339944
H 5.134403 2.796220 0.388934
H 7.449413 1.950042 1.037984
H 4.486746 -2.257285 -0.772137
H 8.889786 -0.541158 1.080664
H -3.926694 3.591615 0.212802
H 6.416973 -3.810062 -0.398404
H 8.584005 -2.968631 0.515539
H -8.375008 -0.684724 -0.418397
H -7.791295 0.797061 -1.273117
H -8.108931 0.855391 0.488677
H -3.374996 -3.522697 0.615325
H -4.744425 -3.916994 -0.502265
H -5.039805 -3.825992 1.256470


